2-[(Diethylamino)methyl]cyclopentanone hydrochloride

Base Information

• Chemical Name: 2-[(Diethylamino)methyl]cyclopentanone hydrochloride
• CAS No.: 82343-79-1
• Molecular Formula: C₁₀H₁₉NO
• Molecular Weight: 169.267
• Hs Code.: 2922399090
• DSSTox Substance ID: DTXSID70377771
• Mol file: 82343-79-1.mol

Synonyms:2-[(Diethylamino)methyl]cyclopentanone hydrochloride;82343-79-1;2-(diethylaminomethyl)cyclopentan-1-one;hydrochloride;MFCD01861908;37408-88-1;2-((Diethylamino)methyl)cyclopentanone hydrochloride;DTXSID70377771;GEO-01036;AKOS005258048;MS-20190;FT-0608773;2-[(Diethylamino)methyl]cyclopentan-1-one--hydrogen chloride (1/1)

Chemical Property of 2-[(Diethylamino)methyl]cyclopentanone hydrochloride

Chemical Property:

• Vapor Pressure: 0.0396mmHg at 25°C
• Boiling Point: 239.7°C at 760 mmHg
• PKA: 9.80±0.25(Predicted)
• Flash Point: 74.9°C
• PSA: 20.31000
• Density: 0.942±0.06 g/cm3(Predicted)
• LogP: 2.49940
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 205.1233420
• Heavy Atom Count: 13
• Complexity: 152

Purity/Quality:

98%Min ^*data from raw suppliers

2-[(Diethylamino)methyl]cyclopentanoneHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CC1CCCC1=O.Cl

Technology Process of 2-[(Diethylamino)methyl]cyclopentanone hydrochloride

There total 7 articles about 2-[(Diethylamino)methyl]cyclopentanone hydrochloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

diethyl(methoxymethyl)amine (5888-29-9) + 1-(trimethylsilyloxy)cyclopentene (19980-43-9) → 2-(Diethylaminomethyl)cyclopentanon (82343-79-1) + 2-methylenecyclopentanone (1489-50-5)

Guidance literature:

With dicyclohexylmethylamine; trimethylsilyl iodide; In acetonitrile; for 4h; Ambient temperature;

DOI:10.1016/S0040-4039(00)86885-9

Reference yield:

N-(ethoxymethyl)diethylamine (7352-03-6) → 2-(Diethylaminomethyl)cyclopentanon (82343-79-1)

Guidance literature:

Multi-step reaction with 2 steps

1: methyltrichlorosilane / acetonitrile / 0.08 h / 10 °C

2: acetonitrile / 0 °C

With Methyltrichlorosilane; In acetonitrile;

DOI:10.1055/s-1986-31742

Reference yield:

cyclopentanone (120-92-3) → 2-(Diethylaminomethyl)cyclopentanon (82343-79-1)

Guidance literature:

Multi-step reaction with 2 steps

1: triethylamine, sodium iodide / acetonitrile / 0.25 h / Ambient temperature

2: acetonitrile / 0 °C

With triethylamine; sodium iodide; In acetonitrile;

DOI:10.1055/s-1986-31742

upstream raw materials:

formaldehyd

diethyl amine hydrochloride

cyclopentanone

diethyl(methoxymethyl)amine

Downstream raw materials:

2-diethylaminomethyl-1-phenyl-cyclopentanol

Refernces

• 1、 Hosomi, Akira,Iijima, Susumu,Sakurai, Hideki. "A NOVEL AMINOMETHYLATION OF SILYL ENOL ETHERS WITH AMINOMETHYL ETHERS CATALYZED BY IODOTRIMETHYLSILANE OR TRIMETHYLSILYL TRIFLUOROMETHANESULFONATE". . p. 547 - 550. Retrieved 2007/10/02.